Ethyl (3-formyl-4-nitro-phenyl) carbonate

HCID 339208

Basic information

CAS
59342-81-3
Standard SMILES
CCOC(=O)Oc1ccc([N+](=O)[O-])c(C=O)c1
InChIKey
XDSNNVUKVKTMCB-UHFFFAOYSA-N
Molecular formula
C10H9NO6
Average molar mass
239.18 g/mol
Monoisotopic mass
239.04298701

Overview

See also: Ethyl 3-formyl-4-nitrophenyl carbonate (annotation moved to).

Names & identifiers

Preferred name
Ethyl (3-formyl-4-nitro-phenyl) carbonate
IUPAC
ethyl (3-formyl-4-nitrophenyl) carbonate

Names & synonyms

59342-81-3ethyl (3-formyl-4-nitro-phenyl) carbonateethyl (3-formyl-4-nitrophenyl) carbonateNSC364655SCHEMBL8577525DTXSID30320804XDSNNVUKVKTMCB-UHFFFAOYSA-N3-formyl-4-nitrophenyl ethyl carbonateNSC-364655DS-000061ETHYL 3-FORMYL-4-NITROPHENYL CARBONATE10.14272/XDSNNVUKVKTMCB-UHFFFAOYSA-N.1
Show more names
doi:10.14272/XDSNNVUKVKTMCB-UHFFFAOYSA-N.1

Database identifiers

CAS
59342-81-3
PubChem CID
339208
DTXSID
DTXSID30320804

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
98.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
17

Related reactions

3 records

Compound notes

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